olodaterol hydrochloride

Properties Image MNX_ID MNXM107404 reference chebi:83309 formula C21H27ClN2O5 global charge 0 mol weight 422.909 InChIKey KCEHVJZZIGJAAW-FERBBOLQSA-N InChI InChI=1S/C21H26N2O5.ClH/c1-21(2,10-13-4-6-15(27-3)7-5-13)22-11-18(25)16-8-14(24)9-17-20(16)28-12-19(26)23-17;/h4-9,18,22,24-25H,10-12H2,1-3H3,(H,23,26);1H/t18-;/m0./s1 SMILES COC1=CC=C(CC(C)(C)NC[C@H](O)C2=CC(O)=CC3=C2OCC(=O)N3)C=C1.Cl MNX internals InChI (mnx) InChI=1/C21H26N2O5.ClH/c1-21(2,10-13-4-6-15(27-3)7-5-13)22-11-18(25)16-8-14(24)9-17-20(16)28-12-19(26)23-17;/h4-9,18,22,24-25H,10-12H2,1-3H3,(H,23,26);1H/t18-;/m0./s1 SMILES (mnx) [CH3:1][C:21]([CH3:2])([CH2:10][C:13]1=[CH:5][CH:7]=[C:15]([O:27][CH3:3])[CH:6]=[CH:4]1)[NH:22][CH2:11][C@@H:18]([C:16]1=[C:20]2[C:17](=[CH:9][C:14]([OH:24])=[CH:8]1)[N:23]=[C:19]([OH:26])[CH2:12][O:28]2)[OH:25].[ClH:29]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0